2-(furan-2-ylcarbonyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-[3-(2-oxo-1-azepanyl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-[3-(2-ketoazepan-1-yl)propyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CO4

InChI

InChI=1S/C24H29N3O4/c28-22-11-2-1-5-13-26(22)14-7-12-25-23(29)20-16-18-8-3-4-9-19(18)17-27(20)24(30)21-10-6-15-31-21/h3-4,6,8-10,15,20H,1-2,5,7,11-14,16-17H2,(H,25,29)